N-{[1-(but-2-ynoyl)piperidin-4-yl]methyl}-3-(2-methoxyphenyl)propanamide
Chemical Structure Depiction of
N-{[1-(but-2-ynoyl)piperidin-4-yl]methyl}-3-(2-methoxyphenyl)propanamide
N-{[1-(but-2-ynoyl)piperidin-4-yl]methyl}-3-(2-methoxyphenyl)propanamide
Compound characteristics
| Compound ID: | T002-4726 |
| Compound Name: | N-{[1-(but-2-ynoyl)piperidin-4-yl]methyl}-3-(2-methoxyphenyl)propanamide |
| Molecular Weight: | 342.44 |
| Molecular Formula: | C20 H26 N2 O3 |
| Smiles: | CC#CC(N1CCC(CC1)CNC(CCc1ccccc1OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5449 |
| logD: | 2.5449 |
| logSw: | -2.5237 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.461 |
| InChI Key: | CWCHMEIYUFGDNH-UHFFFAOYSA-N |